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Murcko scaffold

Ring system with 6 rings and 26 atoms

6 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
26
Chemicals
6
With full pages
2
Scaffold SMILES

O=C1OCC2Cc3cc4c(cc3C(c3ccc5c(c3)OCO5)C12)OCO4

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold O=C1OCC2Cc3cc4c(cc3C(c3ccc5c(c3)OCO5)C12)OCO4

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 6 of 6 chemicals

Polygamain chemical structure, C20H16O6, CAS 71640-49-8
Polygamain
CAS 71640-49-8C20H16O6
(5R,5aR,8aR)-5,8,8a,9-Tetrahydro-5-(7-methoxy-1,3-benzodioxol-5-yl)furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one chemical structure, C21H18O7, CAS 55955-07-2
(5R,5aR,8aR)-5,8,8a,9-Tetrahydro-5-(7-methoxy-1,3-benzodioxol-5-yl)furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one
CAS 55955-07-2C21H18O7
Picropolygamain chemical structure, C20H16O6, CAS 98819-09-1
Picropolygamain
CAS 98819-09-1C20H16O6
Austrobailignan 2 chemical structure, C21H18O7, CAS 55890-20-5
Austrobailignan 2
CAS 55890-20-5C21H18O7
Burseranin chemical structure, C21H18O7, CAS 852920-06-0
Burseranin
CAS 852920-06-0C21H18O7
Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-5-carbonitrile, 9-(1,3-benzodioxol-5-yl)-5,5a,6,8,8a,9-hexahydro-4-methoxy-8-oxo-, (5S,5aR,8aR,9R)- chemical structure, C22H17NO7, CAS 1395895-57-4
Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-5-carbonitrile, 9-(1,3-benzodioxol-5-yl)-5,5a,6,8,8a,9-hexahydro-4-methoxy-8-oxo-, (5S,5aR,8aR,9R)-
CAS 1395895-57-4C22H17NO7